(1,1,4a-trimethyl-5-methylidene-6-oxidanylidene-2,3,4,7,8,8a-hexahydronaphthalen-2-yl) benzoate

Systemtic Name: (1,1,4a-trimethyl-5-methylidene-6-oxidanylidene-2,3,4,7,8,8a-hexahydronaphthalen-2-yl) benzoate Openeye Name: (1,1,4a-trimethyl-5-methylene-6-oxo-decalin-2-yl) benzoate CAS Name: benzoic acid (1,1,4a-trimethyl-5-methylene-6-oxo-2,3,4,7,8,8a-hexahydronaphthalen-2-yl) ester IUPAC Name: (1,1,4a-trimethyl-5-methylidene-6-oxo-2,3,4,7,8,8a-hexahydronaphthalen-2-yl) benzoate Traditional Name: benzoic acid (6-keto-1,1,4a-trimethyl-5-methylene-decalin-2-yl) ester Formula: C21H26O3 MolecularWeight: 326.42934

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C2CCC(=O)C(=C)C2(CCC1OC(=O)C3=CC=CC=C3)C)C

Isomeric SMILES

CC1(C2CCC(=O)C(=C)C2(CCC1OC(=O)C3=CC=CC=C3)C)C

InChI

InChI=1S/C21H26O3/c1-14-16(22)10-11-17-20(2,3)18(12-13-21(14,17)4)24-19(23)15-8-6-5-7-9-15/h5-9,17-18H,1,10-13H2,2-4H3